SCHEMBL14905348

SCHEMBL14905348

COc1ccc2ncc(Br)c(Cl)c2n1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.41
PTPN11 Q06124 8/20 0.37
MAP4K4 O95819 1/20 0.35
KCNH2 Q12809 3/20 0.34
NQO2 P16083 1/20 0.34
PDE10A Q9Y233 2/20 0.34
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
HDAC3 O15379 1/20 0.33
APP P05067 1/20 0.33
ACHE P22303 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
PDE2A O00408 1/20 0.33
PDE7A Q13946 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29971220 0.87 PTPN11 (0.39) EGFRPTPN11NQO2
SCHEMBL21631626 0.87 PTPN11 (0.39) EGFRPTPN11NQO2
SCHEMBL28867703 0.83 PTPN11 (0.38) EGFRPTPN11MAP4K4KCNH2PDE10A
SCHEMBL2040415 0.83 EGFR (0.43) EGFRMAP4K4KCNH2NQO2PDE10A
SCHEMBL29692882 0.81 EGFR (0.41) EGFRMAP4K4KCNH2PDE10APDGFRB
SCHEMBL4502318 0.81 KCNH2 (0.43) EGFRPTPN11KCNH2
SCHEMBL621649 0.81 EGFR (0.41) EGFRMAP4K4KCNH2NQO2PDE10A
SCHEMBL4507986 0.81 MAP4K4 (0.41) EGFRPTPN11MAP4K4KCNH2PDE10A
SCHEMBL1075499 0.81 EGFR (0.41) EGFRMAP4K4KCNH2PDE10APDGFRB
SCHEMBL26921411 0.80 PTPN11 (0.36) EGFRPTPN11MAP4K4NQO2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2861584-B1 Pyridopyrazine and naphthyridine derivatives for the treatment of cancer ASTEX THERAPEUTICS LTD (GB) 2020-02-19 EP disclosed
EP-2776436-B1 NEW COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2019-03-13 EP disclosed
US-9757364-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2017-09-12 US disclosed
US-9757364-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2017-09-12 US disclosed
US-9737544-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2017-08-22 US disclosed
US-9737544-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2017-08-22 US disclosed
US-20170105978-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2017-04-20 US disclosed
US-20170105978-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2017-04-20 US disclosed
US-9527844-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-12-27 US disclosed
US-9527844-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-12-27 US disclosed
US-20160108034-A1 NAPHTHYRIDINE DERIVATIVE COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2016-04-21 US disclosed
US-9309241-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2016-04-12 US disclosed
US-9309241-B2 Naphthyridine derivative compounds ASTEX THERAPEUTICS LTD (GB) 2016-04-12 US disclosed
US-9303030-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-04-05 US disclosed
US-9303030-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-04-05 US disclosed
US-20150239883-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-08-27 US disclosed
US-20150239883-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-08-27 US disclosed
US-20150057293-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-02-26 US disclosed
US-20150057293-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-02-26 US disclosed
WO-2013061077-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2013-05-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150057293-A1 NEW COMPOUNDS NQO1, NTPCR, NDC1 EGFR 1182/4885PTPN11 2011/4885MAP4K4 1455/4885
US-20170105978-A1 NEW COMPOUNDS NQO1, NTPCR, NDC1 EGFR 1182/4885PTPN11 2011/4885MAP4K4 1455/4885
US-20160108034-A1 NAPHTHYRIDINE DERIVATIVE COMPOUNDS NQO1, NDC1, NTPCR EGFR 1282/4885PTPN11 1808/4885MAP4K4 1079/4885
US-20150239883-A1 NEW COMPOUNDS NTPCR, MT-ND5, NQO1 EGFR 1974/4885PTPN11 941/4885MAP4K4 602/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.